Anti-COVID drugs: repurposing existing drugs or search for new complex entities, strategies and perspectives.
COVID-19
SARS-CoV-2
antiviral drugs
double hit effect
hybrid drugs
oleanolic acid
repurposing
Journal
Future medicinal chemistry
ISSN: 1756-8927
Titre abrégé: Future Med Chem
Pays: England
ID NLM: 101511162
Informations de publication
Date de publication:
10 2020
10 2020
Historique:
pubmed:
24
7
2020
medline:
4
11
2020
entrez:
24
7
2020
Statut:
ppublish
Résumé
At the end of 2019, a novel virus causing severe acute respiratory syndrome to spread globally. There are currently no effective drugs targeting SARS-CoV-2. In this study, based on the analysis of numerous references and selected methods of computational chemistry, the strategy of integrative structural modification of small molecules with antiviral activity into potential active complex molecules has been presented. Proposed molecules have been designed based on the structure of triterpene oleanolic acid and complemented by structures characteristic of selected anti-COVID therapy assisted drugs. Their pharmaceutical molecular parameters and the preliminary bioactivity were calculated and predicted. The results of the above analyses show that among the designed complex substances there are potential antiviral agents directed mainly on SARS-CoV-2.
Identifiants
pubmed: 32698626
doi: 10.4155/fmc-2020-0204
pmc: PMC7377048
doi:
Substances chimiques
Antiviral Agents
0
Cardiovascular Agents
0
Drugs, Chinese Herbal
0
Oleanolic Acid
6SMK8R7TGJ
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM
Pagination
1743-1757Références
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